Cas no 446254-90-6 (BENZENE, 1,2,3-TRIBROMO-4-(2,3,6-TRIBROMOPHENOXY)-)

BENZENE, 1,2,3-TRIBROMO-4-(2,3,6-TRIBROMOPHENOXY)- structure
446254-90-6 structure
Product Name:BENZENE, 1,2,3-TRIBROMO-4-(2,3,6-TRIBROMOPHENOXY)-
CAS No:446254-90-6
MF:C12H4Br6O
MW:643.583559036255
CID:3365523
PubChem ID:86208448
Update Time:2025-04-21

BENZENE, 1,2,3-TRIBROMO-4-(2,3,6-TRIBROMOPHENOXY)- Chemical and Physical Properties

Names and Identifiers

    • BENZENE, 1,2,3-TRIBROMO-4-(2,3,6-TRIBROMOPHENOXY)-
    • PBDE 132
    • UNII-52YSX4G22I
    • 2,2',3,3',4,6'-Hexabromodiphenyl ether
    • 52YSX4G22I
    • DTXSID20879937
    • Q27261032
    • 446254-90-6
    • BDE-132
    • Inchi: 1S/C12H4Br6O/c13-5-3-4-8(11(18)9(5)16)19-12-7(15)2-1-6(14)10(12)17/h1-4H
    • InChI Key: FFEKBOKDYRZGRV-UHFFFAOYSA-N
    • SMILES: C1(Br)=CC=C(OC2=C(Br)C=CC(Br)=C2Br)C(Br)=C1Br

Computed Properties

  • Exact Mass: 643.53009Da
  • Monoisotopic Mass: 637.53624Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 304
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 7.6
  • Topological Polar Surface Area: 9.2?2
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